SCHEMBL6089306

SCHEMBL6089306

Cc1[nH]c(C=C2C(=O)NN=C2CCc2ccc(O)cc2)c(C)c1C(=O)OCCN(C)C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 4/20 0.44
FGFR1 P11362 4/20 0.44
ABL1 P00519 1/20 0.44
RET P07949 1/20 0.44
FLT3 P36888 1/20 0.44
ALK Q9UM73 1/20 0.44
PRKAA1 Q13131 11/20 0.39
PRKAA2 P54646 10/20 0.39
KDR P35968 8/20 0.38
CHEK1 O14757 1/20 0.35
EGFR P00533 1/20 0.34
CSF1R P07333 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6089296 1.00 PDGFRB (0.44) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6092643 0.92 PDGFRB (0.43) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6092170 0.92 FGFR1 (0.48) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6092165 0.92 FGFR1 (0.48) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6091575 0.84 KDR (0.56) PDGFRBFGFR1RETFLT3PRKAA1
SCHEMBL6091561 0.84 KDR (0.56) PDGFRBFGFR1RETFLT3PRKAA1
SCHEMBL6088027 0.78 PDGFRB (0.48) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6091642 0.77 PDGFRB (0.43) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6091648 0.77 PDGFRB (0.43) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6087845 0.77 PDGFRB (0.43) PDGFRBFGFR1ABL1RETFLT3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7060822-B1 2-pyrazolin-5-ones ABBOTT GMBH & CO. KG (DE) 2006-06-13 US disclosed